2-Acetylflexuosin A
TL;DR: 2-Acetylflexuosin A (CAS 33627-28-0) is a chemical compound with molecular formula C19H26O7 and molecular weight 366.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-acetyloxy-8-hydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate
Also Known As: Britannin, Britanin, 2-Acetylflexuosin A, (9-acetyloxy-8-hydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate, [(3aS,5R,5aS,6S,8S,8aS,9S,9aR)-9-acetyloxy-8-hydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl] acetate
| Molecular Formula | C19H26O7 |
|---|---|
| Molecular Weight | 366.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.16785 |
| Heavy Atoms | 26 |
| Complexity | 656.0 |
Chemical Identifiers
| CAS Number | 33627-28-0 |
|---|---|
| SMILES | CC1CC2C(C(C3(C1C(CC3O)OC(=O)C)C)OC(=O)C)C(=C)C(=O)O2 |
| InChIKey | JXEGMONJOSAULB-UHFFFAOYSA-N |
Product Overview
2-Acetylflexuosin A (CAS 33627-28-0), with molecular formula C19H26O7 and molecular weight 366.17 g/mol. IUPAC: (9-acetyloxy-8-hydroxy-5,8a-dimethyl-1-methylidene-2-oxo-4,5,5a,6,7,8,9,9a-octahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate.
Chemical Property Profile of 2-Acetylflexuosin A
Property Insights of 2-Acetylflexuosin A
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetylflexuosin A. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetylflexuosin A. Following Lipinski's Rule of Five, 2-Acetylflexuosin A has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Acetylflexuosin A?
The CAS number of 2-Acetylflexuosin A is 33627-28-0.
What is the molecular formula of 2-Acetylflexuosin A?
The molecular formula of 2-Acetylflexuosin A is C19H26O7.
What is the molecular weight of 2-Acetylflexuosin A?
The molecular weight of 2-Acetylflexuosin A is 366.17 g/mol.
Where can I buy 2-Acetylflexuosin A?
You can request a quote for 2-Acetylflexuosin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetylflexuosin A?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetylflexuosin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.